MCULE-7766194789
- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
![]() Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
![]() Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 6 USD | 98 | 22 working days | Get Quote |
| 5 mg | 6 USD | 98 | 22 working days | Get Quote |
| 10 mg | 6 USD | 98 | 22 working days | Get Quote |
- 1-Click Docking Predict the binding orientation and affinity of the ligand to a target.
- Toxicity checker Searching for substructures commonly found in toxic and promiscuous ligands.
- Property calculator Create a physicochemical property profile for the compound in a second.
- Similarity search Find analogs by similarity search.
- Substructure search Find analogs by substructure search.
| Name | File |
|---|---|
| SDF | MCULE-7766194789.sdf |
| SMILES | MCULE-7766194789.smiles |
| Standard InChI | MCULE-7766194789.inchi |
| InChIKey | MCULE-7766194789.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867535336 | 98 | As is | in stock |
| P-875690423 | N/A | As is | in stock |
| P-505393488 | 98 | As is | in stock |
| P-903010136 | 99 | As is | 500 g |
| P-606934366 | N/A | As is | in stock |
| P-596936104 | 99 | As is | 500 g |
| P-872728189 | 98 | As is | in stock |
| P-895930736 | 95 | As is | by resynthesis (? - ? days) |
| P-864171573 | 98 | As is | in stock |
| P-580700869 | 98 | As is | 625.1 g |
| P-893237184 | 95 | As is | in stock |
| P-851206914 | 95 | As is | in stock |
| P-20005710 | 90 | As is | in stock |
| P-851268579 | 95 | As is | by synthesis |
| P-868602548 | 98 | As is | in stock |
| P-34784019 | 90 | As is | by synthesis |
| P-500418142 | 99 | As is | in stock |
| P-504494401 | 90 | As is | by synthesis |
| P-502596460 | 90 | As is | in stock |
| P-488556047 | 92 | As is | in stock |
| P-596548736 | 97 | As is | 1.112 g |
| P-14176154 | 90 | As is | 180 mg |
| P-35171157 | 90 | As is | 23.452 kg |
| P-896628006 | 95 | As is | by synthesis |
| P-863733466 | 95 | As is | in stock |
| P-871075921 | 95 | As is | in stock |
| P-608270200 | 98 | As is | in stock |
| P-889868802 | 95 | As is | by synthesis |
| P-23821589 | 90 | As is | in stock |
| P-579711934 | N/A | As is | in stock |
| P-869108060 | 95 | As is | by synthesis |
| P-892286716 | 95 | As is | 1.004 g |
| P-888627099 | 95 | As is | 1.004 g |
| P-22814625 | 90 | As is | in stock |
| P-888430555 | 94 | As is | by resynthesis (? - ? days) |
| P-568895 | 90 | As is | 4.478 g |
| P-480472759 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 355.394 |
| logP | 2.974 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 8 |
| PSA | 162.08 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 84.9262 |
| Atoms | 36 |
| Rings | 2 |
| Heavy atoms | 23 |
| Hydrogen atoms | 13 |
| Heteroatoms | 10 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

